Chem
J-GLOBAL ID：200907068945964980   Nikkaji number：J1.310.310K

R-99224

R-99224
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C18H20FNO3S
Molecular formula furigana： C18-H20-F-N-O3-S
Molecular weight： 349.420
InChI： InChI=1S/C18H20FNO3S/c19-14-4-2-1-3-13(14)17(18(23)11-5-6-11)20-8-7-15(24)12(10-20)9-16(21)22/h1-4,9,11,15,17,24H,5-8,10H2,(H,21,22)/b12-9-
InChI key： ZWUQVNSJSJHFPS-XFXZXTDPSA-N
SMILES： OC(=O)/C=C\1/CN(CCC1S)C(C(=O)C1CC1)c1ccccc1F
Systematic name  (3)：
  • [(Z)-1-[α-(シクロプロピルカルボニル)-2-フルオロベンジル]-4-メルカプトピペリジン-3-イリデン]酢酸
  • 2-[(3Z)-1-[2-シクロプロピル-1-(2-フルオロフェニル)-2-オキソエチル]-4-スルファニルピペリジン-3-イリデン]酢酸
  • 2-[(3Z)-1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4-sulfanylpiperidin-3-ylidene]acetic acid
Other name (2)：
  • [(Z)-1-[α-(Cyclopropylcarbonyl)-2-fluorobenzyl]-4-mercaptopiperidine-3-ylidene]acetic acid
  • R-99224
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